Information card for entry 4119688

Structure parameters

• Common name: MB-V-50
• Chemical name: complex10
• Formula: C24 H31 F7 N P Rh Sb
• Calculated formula: C24 H31 F7 N P Rh Sb
• Title of publication: Mechanistic Study of the Oxidative Coupling of Styrene with 2-Phenylpyridine Derivatives Catalyzed by Cationic Rhodium(III) via C-H Activation
• Authors of publication: Mikaël Brasse; Juan Cámpora; Jonathan A. Ellman; Robert G. Bergman
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2013
• Journal volume: 135
• Pages of publication: 6427 - 6430
• a: 13.3629 ± 0.0011 Å
• b: 13.2614 ± 0.0011 Å
• c: 15.0885 ± 0.0012 Å
• α: 90°
• β: 104.043 ± 0.004°
• γ: 90°
• Cell volume: 2593.9 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0559
• Residual factor for significantly intense reflections: 0.0552
• Weighted residual factors for significantly intense reflections: 0.1243
• Weighted residual factors for all reflections included in the refinement: 0.1246
• Goodness-of-fit parameter for all reflections included in the refinement: 1.336
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No